SCHEMBL11024233

SCHEMBL11024233

CNc1ccc(Nc2ccc(NCC(C)C)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 2/20 0.50
▸ GNB1 P62873 2/20 0.50
▸ MAPK1 P28482 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ NSD2 O96028 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ PRKCA P17252 1/20 0.42
▸ TOP2B Q02880 1/20 0.42
▸ IDO1 P14902 1/20 0.41
▸ PABPC1 P11940 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15257817 0.90 MEN1 (0.49) MAPK1RAB9AMAPTMEN1KMT2A
SCHEMBL2421375 0.85 MEN1 (0.54) MAPK1RAB9AMAPTMEN1KMT2A
SCHEMBL10808856 0.82 GNG2 (0.53) GNG2GNB1MAPK1RAB9AMAPT
SCHEMBL10811570 0.80 GNG2 (0.55) GNG2GNB1MAPK1MAPTMEN1
SCHEMBL8657009 0.77 POLB (0.50) MAPK1RAB9AMAPTMEN1KMT2A
SCHEMBL30922379 0.76 MAPT (0.59) GNG2GNB1MAPK1RAB9AMAPT
SCHEMBL139752 0.76 MAPT (0.59) GNG2GNB1MAPK1RAB9AMAPT
SCHEMBL31150807 0.76 MAPT (0.59) GNG2GNB1MAPK1RAB9AMAPT
SCHEMBL92477 0.76 P2RY2 (0.55) GNG2GNB1MAPK1RAB9AMAPT
SCHEMBL29377518 0.76 P2RY2 (0.55) GNG2GNB1MAPK1RAB9AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0022209-B1 FLUOR-TRIAZINE DYESTUFFS AND THEIR USE IN DYEING CELLULOSIC FIBROUS MATERIALS BAYER AG (DE) 1985-04-17 — — EP disclosed
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